General Information of the Compound
| Compound ID |
CP0558763
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| Compound Name |
7-[3,5-dimethoxy-N-[2-(propan-2-ylamino)ethyl]anilino]-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one
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| Formula |
C27H37N5O5
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| Molecular Weight |
511.623
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| Canonical SMILES |
COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(OCCN3CCOCC3)c(=O)n2c1
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| InChI |
InChI=1S/C27H37N5O5/c1-20(2)28-7-8-31(22-15-23(34-3)17-24(16-22)35-4)21-5-6-26-29-18-25(27(33)32(26)19-21)37-14-11-30-9-12-36-13-10-30/h5-6,15-20,28H,7-14H2,1-4H3
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| InChIKey |
FESMLQOYIHWLTL-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound